Yangyi Lu

机构：Shenzhen Bay Laboratory · ORCID：0000-0002-1602-1661

发表论文 33 篇 · 总被引 321 次 · h-index 10

代表论文

Multistate Density Functional Theory of Excited States (2022 · The Journal of Physical Chemistry Letters · 被引 57)
Fundamental Variable and Density Representation in Multistate DFT for Excited States (2022 · Journal of Chemical Theory and Computation · 被引 21)
Target State Optimized Density Functional Theory for Electronic Excited and Diabatic States (2023 · Journal of Chemical Theory and Computation · 被引 19)
Minimal Active Space: NOSCF and NOSI in Multistate Density Functional Theory (2022 · Journal of Chemical Theory and Computation · 被引 18)
Multistate Energy Decomposition Analysis of Molecular Excited States (2023 · JACS Au · 被引 16)
Leveling the Mountain Range of Excited-State Benchmarking through Multistate Density Functional Theory (2023 · The Journal of Physical Chemistry A · 被引 11)